{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=507","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=505","results":[{"id":"jvasp-62267","created_at":"2022-09-04T14:35:54.677720Z","updated_at":"2022-09-04T14:35:54.677739Z","structure_string":"Tl4 Zn4 As4 O16\n1.0\n0.000000 9.023057 0.027936\n5.683180 0.000000 0.000000\n0.000000 -0.155789 -8.974342\nTl Zn As O\n4 4 4 16\ndirect\n0.997813 0.988821 0.183690 Tl\n0.002187 0.488821 0.816310 Tl\n0.502305 0.003831 0.326000 Tl\n0.497695 0.503831 0.673999 Tl\n0.178385 0.004755 0.598404 Zn\n0.821616 0.504755 0.401596 Zn\n0.671578 0.963409 0.925167 Zn\n0.328423 0.463409 0.074832 Zn\n0.690250 0.466485 0.065635 As\n0.309750 0.966485 0.934365 As\n0.186634 0.502415 0.399805 As\n0.813366 0.002415 0.600194 As\n0.779896 0.298866 0.571912 O\n0.220104 0.798866 0.428088 O\n0.788647 0.244168 0.981798 O\n0.211353 0.744168 0.018201 O\n0.676070 0.894449 0.712347 O\n0.323930 0.394449 0.287652 O\n0.198048 0.349752 0.566025 O\n0.982770 0.964140 0.688982 O\n0.787434 0.722966 0.038822 O\n0.212566 0.222966 0.961177 O\n0.520380 0.495038 0.974626 O\n0.479621 0.995038 0.025374 O\n0.668259 0.409205 0.252213 O\n0.017230 0.464140 0.311017 O\n0.801952 0.849752 0.433974 O\n0.331741 0.909205 0.747786 O\n","nsites":28,"nelements":4,"elements":["Tl","Zn","As","O"],"chemical_system":"As-O-Tl-Zn","density":5.899314647918037,"density_atomic":0.060846225874972015,"volume":460.17644640005994,"volume_molar":9.897311909491986,"formula_full":"Tl4 Zn4 As4 O16","formula_reduced":"TlZnAsO4","formula_anonymous":"ABCD4","energy_above_hull":1.3932498214285718,"spacegroup":4},{"id":"jvasp-101416","created_at":"2022-09-04T14:36:53.662995Z","updated_at":"2022-09-04T14:36:53.663015Z","structure_string":"Tl1 Zn3\n1.0\n4.303371 -0.000000 -0.000000\n-0.000000 4.303371 -0.000000\n-0.000000 -0.000000 4.303371\nTl Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.500000 0.500000 Zn\n","nsites":4,"nelements":2,"elements":["Tl","Zn"],"chemical_system":"Tl-Zn","density":8.34727731584155,"density_atomic":0.05019189868670327,"volume":79.69413599927574,"volume_molar":11.998232618355544,"formula_full":"Tl1 Zn3","formula_reduced":"TlZn3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":221},{"id":"jvasp-51225","created_at":"2022-09-04T14:36:43.257465Z","updated_at":"2022-09-04T14:36:43.257481Z","structure_string":"Tl1 Zn2 Tc1\n1.0\n-0.000001 3.237953 3.237952\n3.237951 0.000000 3.237952\n3.237952 3.237953 -0.000001\nTl Zn Tc\n1 2 1\ndirect\n0.749999 0.750000 0.749999 Tl\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Zn\n0.499999 0.500000 0.500000 Tc\n","nsites":4,"nelements":3,"elements":["Tl","Zn","Tc"],"chemical_system":"Tc-Tl-Zn","density":10.594913921666118,"density_atomic":0.05891400879767101,"volume":67.89556646428936,"volume_molar":10.221916455697151,"formula_full":"Tl1 Zn2 Tc1","formula_reduced":"TlZn2Tc","formula_anonymous":"ABC2","energy_above_hull":0.5629237249999998,"spacegroup":216},{"id":"jvasp-100515","created_at":"2022-09-04T14:38:39.539802Z","updated_at":"2022-09-04T14:38:39.539823Z","structure_string":"Tl1 W1 O3\n1.0\n4.015267 0.000000 -0.000000\n-0.000000 4.015267 0.000000\n0.000000 0.000000 4.015267\nTl W O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 W\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Tl","W","O"],"chemical_system":"O-Tl-W","density":11.189556556726416,"density_atomic":0.07723723458137008,"volume":64.73561653392002,"volume_molar":7.796939899052994,"formula_full":"Tl1 W1 O3","formula_reduced":"TlWO3","formula_anonymous":"ABC3","energy_above_hull":2.72534862,"spacegroup":221},{"id":"jvasp-86774","created_at":"2022-09-04T14:35:59.274421Z","updated_at":"2022-09-04T14:35:59.274456Z","structure_string":"Tl1 V5 Se8\n1.0\n3.483277 -0.000025 -0.657727\n-0.399153 8.790727 -2.113966\n-0.032841 0.012746 9.379196\nTl V Se\n1 5 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.147270 0.492042 0.294607 V\n0.791714 0.159719 0.583363 V\n0.208288 0.840282 0.416637 V\n0.500001 0.500000 -0.000000 V\n0.852732 0.507960 0.705393 V\n0.662944 0.997260 0.325942 Se\n0.260161 0.347426 0.520283 Se\n0.070998 0.678158 0.142014 Se\n0.739841 0.652576 0.479718 Se\n0.929004 0.321843 0.857986 Se\n0.586215 0.315758 0.172456 Se\n0.337058 0.002741 0.674058 Se\n0.413787 0.684244 0.827544 Se\n","nsites":14,"nelements":3,"elements":["Tl","V","Se"],"chemical_system":"Se-Tl-V","density":6.308767214825064,"density_atomic":0.048762946243180186,"volume":287.1032429046059,"volume_molar":12.34982958160006,"formula_full":"Tl1 V5 Se8","formula_reduced":"TlV5Se8","formula_anonymous":"AB5C8","energy_above_hull":2.7988350380952385,"spacegroup":12},{"id":"jvasp-86172","created_at":"2022-09-04T14:36:21.048037Z","updated_at":"2022-09-04T14:36:21.048068Z","structure_string":"Tl1 V5 Se8\n1.0\n3.483277 -0.000025 -0.657727\n-0.399153 8.790727 -2.113966\n-0.032841 0.012746 9.379196\nTl V Se\n1 5 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.147270 0.492042 0.294607 V\n0.791714 0.159719 0.583363 V\n0.208288 0.840282 0.416637 V\n0.500001 0.500000 -0.000000 V\n0.852732 0.507960 0.705393 V\n0.662944 0.997260 0.325942 Se\n0.260161 0.347426 0.520283 Se\n0.070998 0.678158 0.142014 Se\n0.739841 0.652576 0.479718 Se\n0.929004 0.321843 0.857986 Se\n0.586215 0.315758 0.172456 Se\n0.337058 0.002741 0.674058 Se\n0.413787 0.684244 0.827544 Se\n","nsites":14,"nelements":3,"elements":["Tl","V","Se"],"chemical_system":"Se-Tl-V","density":6.308767214825064,"density_atomic":0.048762946243180186,"volume":287.1032429046059,"volume_molar":12.34982958160006,"formula_full":"Tl1 V5 Se8","formula_reduced":"TlV5Se8","formula_anonymous":"AB5C8","energy_above_hull":2.7988350380952385,"spacegroup":12},{"id":"jvasp-34319","created_at":"2022-09-04T14:37:09.065369Z","updated_at":"2022-09-04T14:37:09.065389Z","structure_string":"Tl1 V3 Cr2 S8\n1.0\n3.298740 -0.000005 -0.630286\n-0.375770 8.469385 -1.966629\n-0.027421 0.082718 8.804060\nTl V Cr S\n1 3 2 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.146312 0.485535 0.292572 V\n0.853688 0.514464 0.707428 V\n0.500000 0.499999 -0.000000 V\n0.204541 0.831557 0.409080 Cr\n0.795459 0.168442 0.590920 Cr\n0.071369 0.672043 0.142738 S\n0.330621 0.006585 0.661236 S\n0.262124 0.350521 0.524251 S\n0.413643 0.684035 0.827332 S\n0.586358 0.315964 0.172667 S\n0.928631 0.327956 0.857261 S\n0.737877 0.649478 0.475748 S\n0.669380 0.993414 0.338764 S\n","nsites":14,"nelements":4,"elements":["Tl","V","Cr","S"],"chemical_system":"Cr-S-Tl-V","density":4.837246240313376,"density_atomic":0.05682272872989575,"volume":246.38028325862987,"volume_molar":10.598119616229575,"formula_full":"Tl1 V3 Cr2 S8","formula_reduced":"TlV3(CrS4)2","formula_anonymous":"AB2C3D8","energy_above_hull":3.2160728571428576,"spacegroup":12},{"id":"jvasp-55312","created_at":"2022-09-04T14:36:43.741763Z","updated_at":"2022-09-04T14:36:43.741778Z","structure_string":"Tl2 V4 Ag2 O12\n1.0\n5.827117 0.045508 0.958436\n1.174022 7.298772 0.399636\n0.078908 0.028966 7.402908\nTl V Ag O\n2 4 2 12\ndirect\n0.250000 0.287894 0.712107 Tl\n0.750000 0.712106 0.287895 Tl\n0.717143 0.630134 0.795639 V\n0.782858 0.204362 0.369867 V\n0.282858 0.369867 0.204362 V\n0.217142 0.795639 0.630134 V\n0.250000 0.894408 0.105593 Ag\n0.750001 0.105593 0.894409 Ag\n0.351774 0.201420 0.050428 O\n0.148226 0.949572 0.798581 O\n0.480178 0.640776 0.666773 O\n0.727555 0.098996 0.575211 O\n0.772446 0.424790 0.901005 O\n0.272446 0.901005 0.424790 O\n0.227554 0.575211 0.098996 O\n0.980179 0.666773 0.640777 O\n0.519822 0.359225 0.333228 O\n0.019822 0.333228 0.359225 O\n0.851774 0.050428 0.201421 O\n0.648226 0.798580 0.949573 O\n","nsites":20,"nelements":4,"elements":["Tl","V","Ag","O"],"chemical_system":"Ag-O-Tl-V","density":5.397715822275791,"density_atomic":0.06372051658791357,"volume":313.8706506311278,"volume_molar":9.45086619266717,"formula_full":"Tl2 V4 Ag2 O12","formula_reduced":"TlV2AgO6","formula_anonymous":"ABC2D6","energy_above_hull":2.4725679260000004,"spacegroup":15},{"id":"jvasp-122999","created_at":"2022-09-04T14:38:54.960630Z","updated_at":"2022-09-04T14:38:54.960658Z","structure_string":"Tl1 V1\n1.0\n3.315845 -0.000000 0.000000\n-0.000000 3.315845 0.000000\n0.000000 -0.000000 3.315845\nTl V\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.499999 0.499999 0.499999 V\n","nsites":2,"nelements":2,"elements":["Tl","V"],"chemical_system":"Tl-V","density":11.629456924661312,"density_atomic":0.05485892994873155,"volume":36.45714566195697,"volume_molar":10.977503144206413,"formula_full":"Tl1 V1","formula_reduced":"TlV","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":221},{"id":"jvasp-11422","created_at":"2022-09-04T14:37:07.035376Z","updated_at":"2022-09-04T14:37:07.035403Z","structure_string":"Tl2 Te6 Mo6\n1.0\n4.815154 -8.340091 -0.000000\n4.815153 8.340091 0.000000\n0.000000 -0.000000 4.609511\nTl Te Mo\n2 6 6\ndirect\n0.666667 0.333333 0.250000 Tl\n0.333333 0.666667 0.750000 Tl\n0.632245 0.692630 0.250000 Te\n0.939614 0.632244 0.750000 Te\n0.692630 0.060385 0.750000 Te\n0.307369 0.939614 0.250000 Te\n0.060385 0.367755 0.250000 Te\n0.367755 0.307370 0.750000 Te\n0.856931 0.028081 0.250000 Mo\n0.828849 0.856930 0.750000 Mo\n0.028082 0.171151 0.750000 Mo\n0.971918 0.828849 0.250000 Mo\n0.171151 0.143069 0.250000 Mo\n0.143069 0.971918 0.750000 Mo\n","nsites":14,"nelements":3,"elements":["Tl","Te","Mo"],"chemical_system":"Mo-Te-Tl","density":7.849156837973115,"density_atomic":0.03781483925757534,"volume":370.22503003752473,"volume_molar":15.925337455437157,"formula_full":"Tl2 Te6 Mo6","formula_reduced":"Tl(TeMo)3","formula_anonymous":"AB3C3","energy_above_hull":3.2304276571428567,"spacegroup":176},{"id":"jvasp-4627","created_at":"2022-09-04T14:36:53.832674Z","updated_at":"2022-09-04T14:36:53.832694Z","structure_string":"Tl2 Te6 Pt4\n1.0\n4.022094 -6.966470 0.000000\n4.022094 6.966470 0.000000\n0.000000 0.000000 5.868668\nTl Te Pt\n2 6 4\ndirect\n0.666667 0.333333 0.686579 Tl\n0.333333 0.666667 0.313421 Tl\n0.830743 0.169256 0.232017 Te\n0.830743 0.661486 0.232017 Te\n0.338513 0.169257 0.232017 Te\n0.661486 0.830743 0.767983 Te\n0.169256 0.830743 0.767983 Te\n0.169257 0.338513 0.767983 Te\n0.000000 0.000000 0.000000 Pt\n-0.000000 0.500000 0.000000 Pt\n0.500000 -0.000000 0.000000 Pt\n0.500000 0.500000 0.000000 Pt\n","nsites":12,"nelements":3,"elements":["Tl","Te","Pt"],"chemical_system":"Pt-Te-Tl","density":9.869502547842943,"density_atomic":0.03648771957114816,"volume":328.8777742495239,"volume_molar":16.5045687447178,"formula_full":"Tl2 Te6 Pt4","formula_reduced":"TlTe3Pt2","formula_anonymous":"AB2C3","energy_above_hull":1.29042145,"spacegroup":164},{"id":"jvasp-105272","created_at":"2022-09-04T14:36:49.482823Z","updated_at":"2022-09-04T14:36:49.482845Z","structure_string":"Tl1 Tc1 O3\n1.0\n3.965106 -0.000000 0.000000\n0.000000 3.965106 0.000000\n-0.000000 -0.000000 3.965106\nTl Tc O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Tc\n0.500000 0.500000 -0.000000 O\n0.500000 0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Tl","Tc","O"],"chemical_system":"O-Tc-Tl","density":9.333098714684684,"density_atomic":0.08020576743667913,"volume":62.339656608203406,"volume_molar":7.5083637404933015,"formula_full":"Tl1 Tc1 O3","formula_reduced":"TlTcO3","formula_anonymous":"ABC3","energy_above_hull":2.29660492,"spacegroup":221}]}